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canSAR834416
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NAMES
    SMILES
    O=C(CCN1CCCCCCC1)NC1=CC2C(=O)c3ccc(NC(=O)CCN4CCCCCCC4)cc3C(=O)C2C=C1
    InChI
    InChI=1S/C34H46N4O4/c39-31(15-21-37-17-7-3-1-4-8-18-37)35-25-11-13-27-29(23-25)33(41)28-14-12-26(24-30(28)34(27)42)36-32(40)16-22-38-19-9-5-2-6-10-20-38/h11-14,23-24,27,29H,1-10,15-22H2,(H,35,39)(H,36,40)
    MOLECULAR FORMULA
    C34H46N4O4
    CROSS REFERENCES
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    canSAR834416

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 574.35
    AlogP 5.12
    HBond donors 2
    HBond acceptors 8
    Atoms 88
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR834416.